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1-(2-Thienyl)-1-pentanone

View entire compound with spectra: 2 FTIR, 1 Raman, and 6 MS (GC)

1-(2-Thienyl)-1-pentanone
SpectraBase Compound ID 1Ds12yLANYY
InChI InChI=1S/C9H12OS/c1-2-3-5-8(10)9-6-4-7-11-9/h4,6-7H,2-3,5H2,1H3
InChIKey KJMPRCVRMAHTBR-UHFFFAOYSA-N
Mol Weight 168.25 g/mol
Molecular Formula C9H12OS
Exact Mass 168.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8I5yfXTBT
Name 1-PENTANONE, 1-(2-THIENYL)-
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 168.060886179 u
Formula C9H12OS
InChI InChI=1S/C9H12OS/c1-2-3-5-8(10)9-6-4-7-11-9/h4,6-7H,2-3,5H2,1H3
InChIKey KJMPRCVRMAHTBR-UHFFFAOYSA-N
Molecular Weight 168.254 g/mol
Nominal Mass 168 u
Number of Peaks 63
SMILES c1sc(cc1)C(=O)CCCC
SPLASH splash10-03fr-2900000000-d00b680f8999d1ec82b0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000672